Geometry & MOs

Info

ID:	413001
PubChem CID:	135085945
Reduced:	NSiO3C18H27 (1)
Stoich.:	ABC3D18E27 (1)
Weight, g/mol:	229.07482
ΔH_f, kcal/mol:	-170.59
Dipole, Da:	4.61
IP(EA), eV:	-8.76(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE,R)-2-methyl-N-(1,1,1-trifluorobutan-2-ylidene)propane-2-sulfinamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C=C(/N2[C@@H](COC2=O)C(C)C)\O[Si](C)(C)C

DOS

IR

Vibrations